2-[3-methyl-7-[3-phenyl-5-(4-phenyl-2-pyridinyl)phenyl]imidazo[4,5-b]pyridin-2-yl]phenol

C36H26N4O — CID 140864553

IUPAC2-[3-methyl-7-[3-phenyl-5-(4-phenyl-2-pyridinyl)phenyl]imidazo[4,5-b]pyridin-2-yl]phenol
SMILESCn1c(-c2ccccc2O)nc2c(-c3cc(-c4ccccc4)cc(-c4cc(-c5ccccc5)ccn4)c3)ccnc21
InChIInChI=1S/C36H26N4O/c1-40-35(31-14-8-9-15-33(31)41)39-34-30(17-19-38-36(34)40)28-20-27(25-12-6-3-7-13-25)21-29(22-28)32-23-26(16-18-37-32)24-10-4-2-5-11-24/h2-23,41H,1H3
InChIKeyGJDHNXGZRBSRDQ-UHFFFAOYSA-N
MW530.63 g/mol
LogP8.40
Rot. Bonds5

About 2-[3-methyl-7-[3-phenyl-5-(4-phenyl-2-pyridinyl)phenyl]imidazo[4,5-b]pyridin-2-yl]phenol

2-[3-methyl-7-[3-phenyl-5-(4-phenyl-2-pyridinyl)phenyl]imidazo[4,5-b]pyridin-2-yl]phenol (PubChem CID 140864553) has the molecular formula C36H26N4O and a molecular weight of 530.63 g/mol. Its IUPAC name is 2-[3-methyl-7-[3-phenyl-5-(4-phenyl-2-pyridinyl)phenyl]imidazo[4,5-b]pyridin-2-yl]phenol.

Molecular Properties

Compound Name2-[3-methyl-7-[3-phenyl-5-(4-phenyl-2-pyridinyl)phenyl]imidazo[4,5-b]pyridin-2-yl]phenol
PubChem CID140864553
Molecular FormulaC36H26N4O
Molecular Weight530.63 g/mol
Exact Mass530.21
IUPAC Name2-[3-methyl-7-[3-phenyl-5-(4-phenyl-2-pyridinyl)phenyl]imidazo[4,5-b]pyridin-2-yl]phenol
SMILESCn1c(-c2ccccc2O)nc2c(-c3cc(-c4ccccc4)cc(-c4cc(-c5ccccc5)ccn4)c3)ccnc21
InChIInChI=1S/C36H26N4O/c1-40-35(31-14-8-9-15-33(31)41)39-34-30(17-19-38-36(34)40)28-20-27(25-12-6-3-7-13-25)21-29(22-28)32-23-26(16-18-37-32)24-10-4-2-5-11-24/h2-23,41H,1H3
InChIKeyGJDHNXGZRBSRDQ-UHFFFAOYSA-N
XLogP8.40
TPSA63.83 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms41
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500530.63
LogP ≤ 58.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-[3-methyl-7-(3-pyridin-2-ylphenyl)imidazo[4,5-b]pyridin-2-yl]phenol
CID 140865477
2-[1-methyl-4-[3-phenyl-5-[4-(4-phenylphenyl)-2-pyridinyl]phenyl]imidazo[4,5-c]pyridin-2-yl]phenol
CID 140864141
2-[3-methyl-7-(3-propan-2-yl-5-pyridin-2-ylphenyl)imidazo[4,5-b]pyridin-2-yl]phenol
CID 140864143
4-tert-butyl-2-[3-phenyl-7-[3-phenyl-5-[4-(4-phenylphenyl)-2-pyridinyl]phenyl]imidazo[4,5-b]pyridin-2-yl]phenol
CID 140864541
3-[1-methyl-4-[3-[4-(4-phenylphenyl)-2-pyridinyl]phenyl]benzimidazol-2-yl]pyridin-4-ol
CID 140864433
4-tert-butyl-2-[7-(3-tert-butyl-5-pyridin-2-ylphenyl)-3-methylimidazo[4,5-b]pyridin-2-yl]phenol
CID 140864095
2,4-ditert-butyl-6-[3-methyl-7-[3-(5-methyl-4-phenyl-2-pyridinyl)-5-phenylphenyl]imidazo[4,5-b]pyridin-2-yl]phenol
CID 140864631
2-[1-(4-benzylphenyl)-4-[3-phenyl-5-(4-phenyl-2-pyridinyl)phenyl]benzimidazol-2-yl]phenol
CID 164742712
2-[1-phenyl-4-[3-(4-phenyl-2-pyridinyl)phenyl]imidazo[4,5-c]pyridin-2-yl]phenol
CID 140864857
2-[3-phenyl-7-[3-(4-phenyl-2-pyridinyl)phenyl]imidazo[4,5-c]pyridin-2-yl]phenol
CID 140864017
2-[1-phenyl-4-[3-phenyl-5-[4-(4-phenylphenyl)-2-pyridinyl]phenyl]benzimidazol-2-yl]pyridin-3-ol
CID 140864165
2-[4-[3-[4-[2-ethenyl-3-methyl-1-(3-phenylphenyl)indol-7-yl]-2-pyridinyl]phenyl]-1-methylbenzimidazol-2-yl]phenol
CID 177093696

Frequently Asked Questions

What is the IUPAC name of 2-[3-methyl-7-[3-phenyl-5-(4-phenyl-2-pyridinyl)phenyl]imidazo[4,5-b]pyridin-2-yl]phenol?
The IUPAC name of 2-[3-methyl-7-[3-phenyl-5-(4-phenyl-2-pyridinyl)phenyl]imidazo[4,5-b]pyridin-2-yl]phenol (CID 140864553) is 2-[3-methyl-7-[3-phenyl-5-(4-phenyl-2-pyridinyl)phenyl]imidazo[4,5-b]pyridin-2-yl]phenol.
What is the SMILES notation for 2-[3-methyl-7-[3-phenyl-5-(4-phenyl-2-pyridinyl)phenyl]imidazo[4,5-b]pyridin-2-yl]phenol?
The canonical SMILES for 2-[3-methyl-7-[3-phenyl-5-(4-phenyl-2-pyridinyl)phenyl]imidazo[4,5-b]pyridin-2-yl]phenol is Cn1c(-c2ccccc2O)nc2c(-c3cc(-c4ccccc4)cc(-c4cc(-c5ccccc5)ccn4)c3)ccnc21.
What is the InChIKey of 2-[3-methyl-7-[3-phenyl-5-(4-phenyl-2-pyridinyl)phenyl]imidazo[4,5-b]pyridin-2-yl]phenol?
The InChIKey is GJDHNXGZRBSRDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C36H26N4O/c1-40-35(31-14-8-9-15-33(31)41)39-34-30(17-19-38-36(34)40)28-20-27(25-12-6-3-7-13-25)21-29(22-28)32-23-26(16-18-37-32)24-10-4-2-5-11-24/h2-23,41H,1H3.
What are the key properties of 2-[3-methyl-7-[3-phenyl-5-(4-phenyl-2-pyridinyl)phenyl]imidazo[4,5-b]pyridin-2-yl]phenol?
2-[3-methyl-7-[3-phenyl-5-(4-phenyl-2-pyridinyl)phenyl]imidazo[4,5-b]pyridin-2-yl]phenol has a molecular weight of 530.63 g/mol, XLogP of 8.40, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-methyl-7-[3-phenyl-5-(4-phenyl-2-pyridinyl)phenyl]imidazo[4,5-b]pyridin-2-yl]phenol is sourced from PubChem (CID 140864553), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).